APIOCARPIN

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H18O5
Molecular Weight	338.3539
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12COC3=C(C(O)=CC4=C3C[C@H](O4)C(C)=C)[C@]1([H])OC5=C2C=CC(O)=C5

InChI

InChIKey=CCQYTBSOADZYAG-ZQGRQUNCSA-N

InChI=1S/C20H18O5/c1-9(2)15-6-12-17(24-15)7-14(22)18-19(12)23-8-13-11-4-3-10(21)5-16(11)25-20(13)18/h3-5,7,13,15,20-22H,1,6,8H2,2H3/t13-,15-,20+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H18O5
Molecular Weight	338.3539
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:11:43 GMT 2023` Edited by `admin` on `Sat Dec 16 11:11:43 GMT 2023`
Record UNII	9AY85X8I5M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

APIOCARPIN

Common Name

English

5H-BENZOFURO(3,2-C)FURO(2,3-H)(1)BENZOPYRAN-8,11-DIOL, 2,3,5A,10A-TETRAHYDRO-2-(1-METHYLETHENYL)-, (2S,5AR,10AR)-

Systematic Name

English

5H-BENZOFURO(3,2-C)FURO(2,3-H)(1)BENZOPYRAN-8,11-DIOL, 2,3,5A,10A-TETRAHYDRO-2-(1-METHYLETHENYL)-, (2S-(2.ALPHA.,5A.ALPHA.,10A.ALPHA.))-

Systematic Name

English

Code System Code Type Description

CAS

83919-96-4

Created by admin on Sat Dec 16 11:11:43 GMT 2023 , Edited by admin on Sat Dec 16 11:11:43 GMT 2023

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PUBCHEM

117587659

Created by admin on Sat Dec 16 11:11:43 GMT 2023 , Edited by admin on Sat Dec 16 11:11:43 GMT 2023

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FDA UNII

9AY85X8I5M

Created by admin on Sat Dec 16 11:11:43 GMT 2023 , Edited by admin on Sat Dec 16 11:11:43 GMT 2023

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